cyclohexyl 3-ethylmorpholine-4-carboxylate

C13H23NO3 — CID 70843806

IUPACcyclohexyl 3-ethylmorpholine-4-carboxylate
SMILESCCC1COCCN1C(=O)OC1CCCCC1
InChIInChI=1S/C13H23NO3/c1-2-11-10-16-9-8-14(11)13(15)17-12-6-4-3-5-7-12/h11-12H,2-10H2,1H3
InChIKeyWOXBIHIKBBZYPC-UHFFFAOYSA-N
MW241.33 g/mol
LogP2.57
Rot. Bonds2

About cyclohexyl 3-ethylmorpholine-4-carboxylate

cyclohexyl 3-ethylmorpholine-4-carboxylate (PubChem CID 70843806) has the molecular formula C13H23NO3 and a molecular weight of 241.33 g/mol. Its IUPAC name is cyclohexyl 3-ethylmorpholine-4-carboxylate.

Molecular Properties

Compound Namecyclohexyl 3-ethylmorpholine-4-carboxylate
PubChem CID70843806
Molecular FormulaC13H23NO3
Molecular Weight241.33 g/mol
Exact Mass241.17
IUPAC Namecyclohexyl 3-ethylmorpholine-4-carboxylate
SMILESCCC1COCCN1C(=O)OC1CCCCC1
InChIInChI=1S/C13H23NO3/c1-2-11-10-16-9-8-14(11)13(15)17-12-6-4-3-5-7-12/h11-12H,2-10H2,1H3
InChIKeyWOXBIHIKBBZYPC-UHFFFAOYSA-N
XLogP2.57
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze cyclohexyl 3-ethylmorpholine-4-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl (3S)-3-ethylmorpholine-4-carboxylate
CID 135215862
2-hydroxyethyl 3-ethylmorpholine-4-carboxylate
CID 79349487
2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone
CID 54928560
3-ethylmorpholine-4-carbonyl chloride
CID 79887430
cyclopentyl 2-propylpiperidine-1-carboxylate
CID 112738861
2-(2-aminocyclohexyl)-1-(3-ethylmorpholin-4-yl)ethanone
CID 62782698
5-(3-ethylmorpholin-4-yl)-5-oxopentanoic acid
CID 43611838
2-(1-aminocyclohexyl)-1-(3-ethylmorpholin-4-yl)ethanone
CID 64684792
2-amino-1-(3-ethylmorpholin-4-yl)propan-1-one
CID 43613241
1-(3-ethylmorpholin-4-yl)but-2-en-1-one
CID 78966287
2-(3-ethylmorpholin-4-yl)-2-oxoacetohydrazide
CID 43613615
5-bromo-1-(3-ethylmorpholin-4-yl)pentan-1-one
CID 107908453

Frequently Asked Questions

What is the IUPAC name of cyclohexyl 3-ethylmorpholine-4-carboxylate?
The IUPAC name of cyclohexyl 3-ethylmorpholine-4-carboxylate (CID 70843806) is cyclohexyl 3-ethylmorpholine-4-carboxylate.
What is the SMILES notation for cyclohexyl 3-ethylmorpholine-4-carboxylate?
The canonical SMILES for cyclohexyl 3-ethylmorpholine-4-carboxylate is CCC1COCCN1C(=O)OC1CCCCC1.
What is the InChIKey of cyclohexyl 3-ethylmorpholine-4-carboxylate?
The InChIKey is WOXBIHIKBBZYPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3/c1-2-11-10-16-9-8-14(11)13(15)17-12-6-4-3-5-7-12/h11-12H,2-10H2,1H3.
What are the key properties of cyclohexyl 3-ethylmorpholine-4-carboxylate?
cyclohexyl 3-ethylmorpholine-4-carboxylate has a molecular weight of 241.33 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl 3-ethylmorpholine-4-carboxylate is sourced from PubChem (CID 70843806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).